[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine

C11H16N2 — CID 138571732

IUPAC[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
SMILESNC[C@H]1CCC[C@@H]1c1cccnc1
InChIInChI=1S/C11H16N2/c12-7-9-3-1-5-11(9)10-4-2-6-13-8-10/h2,4,6,8-9,11H,1,3,5,7,12H2/t9-,11+/m1/s1
InChIKeyQXHUNBCKSOYVLF-KOLCDFICSA-N
MW176.26 g/mol
LogP1.92
Rot. Bonds2

About [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine

[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine (PubChem CID 138571732) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine.

Molecular Properties

Compound Name[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
PubChem CID138571732
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
SMILESNC[C@H]1CCC[C@@H]1c1cccnc1
InChIInChI=1S/C11H16N2/c12-7-9-3-1-5-11(9)10-4-2-6-13-8-10/h2,4,6,8-9,11H,1,3,5,7,12H2/t9-,11+/m1/s1
InChIKeyQXHUNBCKSOYVLF-KOLCDFICSA-N
XLogP1.92
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,2R)-2-pyridin-3-ylcyclopropyl]methanamine
CID 86319036
2-(2-pyridin-3-ylcyclohexyl)acetonitrile
CID 82241256
N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
CID 81027798
(2-pyrimidin-5-ylcycloheptyl)methanamine
CID 81010295
2-(aminomethyl)-3-pyridin-3-ylcyclopentan-1-ol
CID 176715587
methyl 2-(2-pyridin-3-ylcycloheptyl)acetate
CID 82244502
(2-isoquinolin-5-ylcyclopentyl)methanamine
CID 81010560
N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
CID 81018367
[2-(3,4-dichlorophenyl)cyclopentyl]methanamine
CID 81010012
(2-pyrazin-2-ylcyclohexyl)methanamine
CID 81010683
[2-(3-cyclopropyloxyphenyl)cycloheptyl]methanamine
CID 114523516
(1S,5R,6R)-8-methyl-6-pyridin-3-yl-8-azabicyclo[3.2.1]octane
CID 10774486

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine?
The IUPAC name of [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine (CID 138571732) is [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine.
What is the SMILES notation for [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine?
The canonical SMILES for [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine is NC[C@H]1CCC[C@@H]1c1cccnc1.
What is the InChIKey of [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine?
The InChIKey is QXHUNBCKSOYVLF-KOLCDFICSA-N. The full InChI is InChI=1S/C11H16N2/c12-7-9-3-1-5-11(9)10-4-2-6-13-8-10/h2,4,6,8-9,11H,1,3,5,7,12H2/t9-,11+/m1/s1.
What are the key properties of [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine?
[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine has a molecular weight of 176.26 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine is sourced from PubChem (CID 138571732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).